diethyl 5-pentyl-4H-isoquinoline-3,3-dicarboxylate

Systemtic Name: diethyl 5-pentyl-4H-isoquinoline-3,3-dicarboxylate Openeye Name: diethyl 5-pentyl-4H-isoquinoline-3,3-dicarboxylate CAS Name: 5-pentyl-4H-isoquinoline-3,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-pentyl-4H-isoquinoline-3,3-dicarboxylate Traditional Name: 5-amyl-4H-isoquinoline-3,3-dicarboxylic acid diethyl ester Formula: C20H27NO4 MolecularWeight: 345.43268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=CC2=C1CC(N=C2)(C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCCCCC1=CC=CC2=C1CC(N=C2)(C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C20H27NO4/c1-4-7-8-10-15-11-9-12-16-14-21-20(13-17(15)16,18(22)24-5-2)19(23)25-6-3/h9,11-12,14H,4-8,10,13H2,1-3H3